1-{3-[(3-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(prop-2-en-1-yl)prolinamide
Chemical Structure Depiction of
1-{3-[(3-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(prop-2-en-1-yl)prolinamide
1-{3-[(3-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(prop-2-en-1-yl)prolinamide
Compound characteristics
| Compound ID: | L027-0574 |
| Compound Name: | 1-{3-[(3-methylbenzene-1-sulfonyl)amino]benzoyl}-N-(prop-2-en-1-yl)prolinamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | Cc1cccc(c1)S(Nc1cccc(c1)C(N1CCCC1C(NCC=C)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6603 |
| logD: | 2.6527 |
| logSw: | -3.0847 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.123 |
| InChI Key: | VTUSRAOMPFFFRH-FQEVSTJZSA-N |